SCHEMBL9315985

SCHEMBL9315985

CCC(CCCCN=C=O)N=C=O.N=C=O.N=C=O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2884848 0.95
SCHEMBL6049704 0.93 NAAA (0.31)
SCHEMBL1953862 0.93 NAAA (0.31)
SCHEMBL21925584 0.93 NAAA (0.31)
SCHEMBL18526790 0.91 NAAA (0.31)
SCHEMBL28175214 0.89
SCHEMBL33016 0.89
SCHEMBL28059453 0.89
SCHEMBL10799741 0.87
Hexane SCHEMBL28850675 0.84 NAAA (0.34)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5316882-A Composites of particles bound with polyesters or polyurethanes EASTMAN KODAK COMPANY (US) 1994-05-31 US disclosed
WO-1993004408-A1 FERRITE GREEN BEADS AND METHOD OF PRODUCING CARRIER PARTICLES EASTMAN KODAK COMPANY (US) 1993-03-04 WO disclosed